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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-104033
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 50
  • Number of elements: 3
  • Element list: ['H', 'C', 'O']
  • Chemical System: C-H-O
  • Density: 1.4288223708729912
  • Atomic Density: 0.11937495173996807
  • Unit Cell Volume: 418.84833686813914
  • Molar Volume: 5.044727283423663
  • Full Formula: H24 C20 O6
  • Reduced Formula: H12C10O3
  • Formula Anonymous: A3B10C12
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2